SCHEMBL5424136

SCHEMBL5424136

Cc1ccc2[nH]cc(-c3c[nH]c4ccc(C(=O)O)cc34)c2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.53
HTR7 P34969 3/20 0.51
ALDH1A1 P00352 3/20 0.50
KDM4E B2RXH2 2/20 0.50
THRB P10828 1/20 0.50
HPGD P15428 1/20 0.50
MAPK1 P28482 1/20 0.50
MAP2K4 P45985 1/20 0.50
MAPKAPK3 Q16644 1/20 0.50
MAPK6 Q16659 1/20 0.50
HSD17B10 Q99714 1/20 0.50
LMNA P02545 1/20 0.50
RAB9A P51151 1/20 0.50
NR4A2 P43354 1/20 0.50
SLC6A4 P31645 1/20 0.45
MTNR1A P48039 1/20 0.45
MTNR1B P49286 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
KIF11 P52732 1/20 0.43
HTR1A P08908 2/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29221029 0.91 RIPK1 (0.51) PTPN1HTR7ALDH1A1KDM4ETHRB
SCHEMBL29221006 0.91 RIPK1 (0.51) PTPN1HTR7ALDH1A1KDM4ETHRB
SCHEMBL29221022 0.88 PRKAB2 (0.52) PTPN1HTR7ALDH1A1KDM4ETHRB
SCHEMBL29221034 0.84 PTPN1 (0.51) PTPN1HTR7ALDH1A1KDM4ETHRB
SCHEMBL30954358 0.84 PTPN1 (0.51) PTPN1HTR7ALDH1A1KDM4ETHRB
SCHEMBL29221024 0.84 PTPN1 (0.60) PTPN1HTR7ALDH1A1KDM4ETHRB
SCHEMBL5429419 0.83 PTPN1 (0.61) PTPN1HTR7KDM4ERAB9A
SCHEMBL5426730 0.83 PTPN1 (0.54) PTPN1HTR7ALDH1A1KDM4ETHRB
SCHEMBL29221075 0.81 PTPN1 (0.54) PTPN1HTR7ALDH1A1KDM4ETHRB
SCHEMBL5423449 0.81 KDM4E (0.57) PTPN1HTR7ALDH1A1KDM4ETHRB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1893576-A1 TREATMENT OF PROTEIN FOLDING DISORDERS QUEEN'S UNIVERSITY AT KINGSTON (CA) 2008-03-05 EP claimed
US-20070015813-A1 Treatment of protein folding disorders QUEEN'S UNIVERSITY AT KINGSTON (CA) 2007-01-18 US claimed
WO-2006125324-A1 TREATMENT OF PROTEIN FOLDING DISORDERS QUEEN'S UNIVERSITY AT KINGSTON (CA) 2006-11-30 WO claimed
EP-1893576-A1 TREATMENT OF PROTEIN FOLDING DISORDERS QUEEN'S UNIVERSITY AT KINGSTON (CA) 2008-03-05 EP disclosed
US-20070015813-A1 Treatment of protein folding disorders QUEEN'S UNIVERSITY AT KINGSTON (CA) 2007-01-18 US disclosed
WO-2006125324-A1 TREATMENT OF PROTEIN FOLDING DISORDERS QUEEN'S UNIVERSITY AT KINGSTON (CA) 2006-11-30 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070015813-A1 Treatment of protein folding disorders HSPA5, TTR, TUFM PTPN1 4634/4885HTR7 1505/4885ALDH1A1 3328/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.